4-oxidanyl-7-[2-(7-phenethyloxyheptan-2-ylamino)ethyl]-3H-1,3-benzothiazol-2-one hydrochloride

Systemtic Name: 4-oxidanyl-7-[2-(7-phenethyloxyheptan-2-ylamino)ethyl]-3H-1,3-benzothiazol-2-one hydrochloride Openeye Name: 4-hydroxy-7-[2-[(1-methyl-6-phenethyloxy-hexyl)amino]ethyl]-3H-1,3-benzothiazol-2-one hydrochloride CAS Name: 4-hydroxy-7-[2-(7-phenethyloxyheptan-2-ylamino)ethyl]-3H-1,3-benzothiazol-2-one hydrochloride IUPAC Name: 4-hydroxy-7-[2-(7-phenethyloxyheptan-2-ylamino)ethyl]-3H-1,3-benzothiazol-2-one hydrochloride Traditional Name: 4-hydroxy-7-[2-[(1-methyl-6-phenethyloxy-hexyl)amino]ethyl]-3H-1,3-benzothiazol-2-one hydrochloride Formula: C24H33ClN2O3S MolecularWeight: 465.04842

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCOCCC1=CC=CC=C1)NCCC2=C3C(=C(C=C2)O)NC(=O)S3.Cl

Isomeric SMILES

CC(CCCCCOCCC1=CC=CC=C1)NCCC2=C3C(=C(C=C2)O)NC(=O)S3.Cl

InChI

InChI=1S/C24H32N2O3S.ClH/c1-18(8-4-3-7-16-29-17-14-19-9-5-2-6-10-19)25-15-13-20-11-12-21(27)22-23(20)30-24(28)26-22;/h2,5-6,9-12,18,25,27H,3-4,7-8,13-17H2,1H3,(H,26,28);1H